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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-10195
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 15
  • Number of elements: 4
  • Element list: ['Ba', 'Sr', 'Ta', 'O']
  • Chemical System: Ba-O-Sr-Ta
  • Density: 7.049762379572075
  • Atomic Density: 0.06333420118449402
  • Unit Cell Volume: 236.83885988085086
  • Molar Volume: 9.508513010936005
  • Full Formula: Ba3 Sr1 Ta2 O9
  • Reduced Formula: Ba3SrTa2O9
  • Formula Anonymous: AB2C3D9
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1